SCHEMBL2520372

SCHEMBL2520372

CCCOOC(=O)C(C)C.CCCOOC(=O)C(C)C.[Zr]

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
LMNA P02545 1/20 0.31
ATM Q13315 1/20 0.31
ESR1 P03372 1/20 0.31
CHRM1 P11229 1/20 0.31
TSHR P16473 1/20 0.31
SLC6A2 P23975 1/20 0.31
KDR P35968 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NAAA Q02083 1/20 0.30
DGKA P23743 1/20 0.30
CHRNB2 P17787 1/20 0.30
CHRNB4 P30926 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2516764 0.88 CYP3A4 (0.34) TSHR
SCHEMBL2517265 0.87 ALDH1A1 (0.45) ALDH1A1HCAR2LMNAATMESR1
SCHEMBL834402 0.84 ALDH1A1 (0.46) ALDH1A1HCAR2LMNAATMESR1
SCHEMBL2841961 0.83 NAAA (0.45) ALDH1A1HCAR2LMNATSHRNAAA
SCHEMBL4678952 0.82 ALDH1A1 (0.33) ALDH1A1HSD17B10HCAR2LMNAATM
SCHEMBL28001750 0.81 NAAA (0.48) ALDH1A1HCAR2LMNATSHRNAAA
SCHEMBL17710662 0.78
Butane SCHEMBL28213268 0.78 ALDH1A1 (0.36) ALDH1A1HSD17B10LMNA
SCHEMBL30934618 0.77 CYP2C19 (0.30) ALDH1A1
SCHEMBL2512732 0.77 CA1 (0.40) ALDH1A1HCAR2ATMTSHRTDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9051435-B2 Silanol condensation catalyst, heat-curable silicone resin composition for sealing photosemiconductors and sealed photosemiconductor using same THE YOKOHAMA RUBBER CO., LTD. (JP) 2015-06-09 US disclosed
US-20140256539-A1 SILANOL CONDENSATION CATALYST, HEAT-CURABLE SILICONE RESIN COMPOSITION FOR SEALING PHOTOSEMICONDUCTORS AND SEALED PHOTOSEMICONDUCTOR USING SAME THE YOKOHAMA RUBBER CO., LTD. (JP) 2014-09-11 US disclosed
US-8772431-B2 Silanol condensation catalyst, heat-curable silicone resin composition for sealing photosemiconductors and sealed photosemiconductor using same THE YOKOHAMA RUBBER CO., LTD. (JP) 2014-07-08 US disclosed
US-20110248314-A1 SILANOL CONDENSATION CATALYST, HEAT-CURABLE SILICONE RESIN COMPOSITION FOR SEALING PHOTOSEMICONDUCTORS AND SEALED PHOTOSEMICONDUCTOR USING SAME THE YOKOHAMA RUBBER CO., LTD. (JP) 2011-10-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110248314-A1 SILANOL CONDENSATION CATALYST, HEAT-CURABLE SILICONE RESIN COMPOSITION FOR SEALING PHOTOSEMICONDUCTORS AND SEALED PHOTOSEMICONDUCTOR USING SAME ASH2L, RCOR1, SEM1 ALDH1A1 1732/4885HSD17B10 2849/4885HCAR2 2423/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.